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Ligand · H2K

H2K · 1-{5-chloro-2-[(3R)-pyrrolidin-3-yloxy]phenyl}-3-(5-cyanopyrazin-2-yl)urea

H2K, 1-{5-chloro-2-[(3R)-pyrrolidin-3-yloxy]phenyl}-3-(5-cyanopyrazin-2-yl)urea (C16 H15 Cl N6 O2, 358.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
H2K
Formula
C16 H15 Cl N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

H2K in 2 structures; the first of them:

  • 4FT5 · Crystal Structure of the CHK1 · H2K A300 · binds LEU15, GLY16, VAL23, ALA36, LYS38, GLU55, VAL68, LEU84 and 10 more
  • 4FT5 · Crystal structure of the CHK1 · H2K A300 · binds LEU15, GLY16, VAL23, ALA36, LYS38, GLU55, VAL68, LEU84 and 10 more

Residues it binds most

GLU 2, LEU 2, GLY 2, SER 2, VAL 2, ALA 2, ASP 2, CYS 2, LYS 2, TYR 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • GOL · Glycerol

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